In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: N-(5-carbamoyl-3-fluoro-2-methyl-phenyl)-1H-triazole-4-carboxamide N-(5-carbamoyl-3-fluoro-2-methyl…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.20 | -0.8 | -13.52 | 4 | 7 | 0 | 114 | 263.232 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.20 | -0.91 | -42.3 | 3 | 7 | -1 | 112 | 262.224 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.